2-(8,9-dimethoxy-3-nitro-6-oxidanylidene-isoquinolino[4,3-c]quinolin-5-yl)ethyl-dimethyl-azanium

Systemtic Name: 2-(8,9-dimethoxy-3-nitro-6-oxidanylidene-isoquinolino[4,3-c]quinolin-5-yl)ethyl-dimethyl-azanium Openeye Name: 2-(8,9-dimethoxy-3-nitro-6-oxo-isoquinolino[4,3-c]quinolin-5-yl)ethyl-dimethyl-ammonium CAS Name: 2-(8,9-dimethoxy-3-nitro-6-oxo-5-isoquinolino[4,3-c]quinolinyl)ethyl-dimethylammonium IUPAC Name: 2-(8,9-dimethoxy-3-nitro-6-oxoisoquinolino[4,3-c]quinolin-5-yl)ethyl-dimethylazanium Traditional Name: 2-(6-keto-8,9-dimethoxy-3-nitro-isoquinolino[4,3-c]quinolin-5-yl)ethyl-dimethyl-ammonium Formula: C22H23N4O5+ MolecularWeight: 423.44182

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN1C2=C3C=C(C=CC3=NC=C2C4=CC(=C(C=C4C1=O)OC)OC)[N+](=O)[O-]

Isomeric SMILES

C[NH+](C)CCN1C2=C3C=C(C=CC3=NC=C2C4=CC(=C(C=C4C1=O)OC)OC)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O5/c1-24(2)7-8-25-21-16-9-13(26(28)29)5-6-18(16)23-12-17(21)14-10-19(30-3)20(31-4)11-15(14)22(25)27/h5-6,9-12H,7-8H2,1-4H3/p+1